4-[(3-iodanylphenyl)amino]-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid

Systemtic Name: 4-[(3-iodanylphenyl)amino]-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid Openeye Name: 4-(3-iodoanilino)-2-isopropyl-2-methyl-4-oxo-butanoic acid CAS Name: 4-(3-iodoanilino)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid IUPAC Name: 4-(3-iodoanilino)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid Traditional Name: 4-(3-iodoanilino)-2-isopropyl-4-keto-2-methyl-butyric acid Formula: C14H18INO3 MolecularWeight: 375.20209

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(CC(=O)NC1=CC(=CC=C1)I)C(=O)O

Isomeric SMILES

CC(C)C(C)(CC(=O)NC1=CC(=CC=C1)I)C(=O)O

InChI

InChI=1S/C14H18INO3/c1-9(2)14(3,13(18)19)8-12(17)16-11-6-4-5-10(15)7-11/h4-7,9H,8H2,1-3H3,(H,16,17)(H,18,19)